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CHEBI:80950 - Fistularin 1

ChEBI IDCHEBI:80950
ChEBI NameFistularin 1
Stars
DownloadsMolfile
FormulaC22H21Br4N3O8
Net Charge0
Average Mass775.039
Monoisotopic Mass770.80621
SMILESCOC1=C(Br)C(O)C2(C=C1Br)CC(C(=O)NCC(O)COc1c(Br)cc(C3CNC(=O)O3)cc1Br)=NO2
InChIInChI=1S/C22H21Br4N3O8/c1-34-18-13(25)4-22(19(31)16(18)26)5-14(29-37-22)20(32)27-6-10(30)8-35-17-11(23)2-9(3-12(17)24)15-7-28-21(33)36-15/h2-4,10,15,19,30-31H,5-8H2,1H3,(H,27,32)(H,28,33)
InChIKeyWZKUTASMIUOUPM-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Fistularin 1 (CHEBI:80950) is a aromatic ether (CHEBI:35618)
Manual XrefsDatabases
C17160KEGG COMPOUND
Registry NumbersSources
CAS:73622-20-5KEGG COMPOUND